trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane

C9H18 — CID 168764244

IUPACtrans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
SMILESCC[C@@H]1C[C@H]1CC(C)C
InChIInChI=1S/C9H18/c1-4-8-6-9(8)5-7(2)3/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKeyFNUSCVRZQKZPLR-RKDXNWHRSA-N
MW126.24 g/mol
LogP3.08
Rot. Bonds3

About trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane

trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane (PubChem CID 168764244) has the molecular formula C9H18 and a molecular weight of 126.24 g/mol. Its IUPAC name is trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane.

Molecular Properties

Compound Nametrans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
PubChem CID168764244
Molecular FormulaC9H18
Molecular Weight126.24 g/mol
Exact Mass126.14
IUPAC Nametrans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
SMILESCC[C@@H]1C[C@H]1CC(C)C
InChIInChI=1S/C9H18/c1-4-8-6-9(8)5-7(2)3/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKeyFNUSCVRZQKZPLR-RKDXNWHRSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.24
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cis-(1S,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 173447814
1-[(1S,2S)-2-ethylcyclopropyl]propan-2-ol
CID 67160266
1-(chloromethyl)-2-(2-methylpropyl)cyclopropane
CID 81357896
N-methyl-1-[(1R,2R)-2-(2-methylpropyl)cyclopropyl]methanamine
CID 94558697
1-methyl-2-(2-methylpropyl)cyclopropane
CID 54305717
1-(2,3-dimethylheptyl)-2-ethylcyclopropane
CID 123157589
1-ethyl-3-methyl-2-(2-methylpropyl)cyclobutane
CID 158664832
1-ethyl-2-[2-(2-ethylcyclopropyl)ethyl]cyclobutane;1,5,9,12,16,20,23,27,31-nonamethyl-3,7,14,18,25,29-hexakis(2-methylpropyl)cyclotritriacontane
CID 91210730
1-ethyl-2-(5-methylhexyl)cyclopropane
CID 123182568
2-methyl-N-[[2-(2-methylpropyl)cyclopropyl]methyl]propan-1-amine
CID 62713714
1-(2-ethylcyclopropyl)-N-methylbutan-2-amine
CID 123849930
[4-ethyl-2-(2-methylpropyl)cyclohexyl]methanamine
CID 81009989

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane?
The IUPAC name of trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane (CID 168764244) is trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane.
What is the SMILES notation for trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane?
The canonical SMILES for trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane is CC[C@@H]1C[C@H]1CC(C)C.
What is the InChIKey of trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane?
The InChIKey is FNUSCVRZQKZPLR-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H18/c1-4-8-6-9(8)5-7(2)3/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1.
What are the key properties of trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane?
trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane has a molecular weight of 126.24 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane is sourced from PubChem (CID 168764244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).